ID: 68062
SMILES:C1C2OC(=O)C(C)=C2CC2c3c(O)c(C(=O)C(=CC)C)c(O)cc3OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.455
CB1 binding score: -16.879
InChIKey:QATKANGRJKMMHT-UHFFFAOYSA-N
ID: 68063
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.404
InChIKey:VDAMXDQEAGSUAY-UHFFFAOYSA-N
ID: 68064
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 68065
SMILES:c1c(CC=C)cc(O)c2c1OC(C)(C)C1CCC(COC(c3ccccc3)=O)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.506
CB1 binding score: -15.633
InChIKey:KXNUIXBDHKGGPL-UHFFFAOYSA-N
ID: 68066
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCCC)c3)C3C=C(C)CCC3C2(C)CC1CC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -16.398
InChIKey:JOYHQQPFHGGNNH-UHFFFAOYSA-N
ID: 68067
SMILES:CC(C)C1(C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.434
InChIKey:IJJORGRCTNFCLN-UHFFFAOYSA-N
ID: 68068
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(O)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.326
InChIKey:GMXJIODDEDUHCQ-UHFFFAOYSA-N
ID: 68069
SMILES:Oc1c(C(=O)C=C(C)C)c(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.207
InChIKey:BRBURENOSACZRE-UHFFFAOYSA-N
ID: 68070
SMILES:C1=CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.433
InChIKey:XWVHJXIRVAAAIY-UHFFFAOYSA-N
ID: 68071
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 68072
SMILES:C(C)(CCCC1(C)CCc2c(cc(C)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 262.393
CB1 binding score: -18.334
InChIKey:QKBTYGXWHOWCRB-UHFFFAOYSA-N
ID: 68073
SMILES:C(c1c(O)c2c(cc1C=O)OC(C)(C)C=C2)CCCCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.749
InChIKey:YUCXHJBWKYPIHZ-UHFFFAOYSA-N
ID: 68074
SMILES:C12CC=C(C=O)CC1c1c(O)cc(CCCCC)cc1OCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.929
InChIKey:KXBLRQUFGZQDQF-UHFFFAOYSA-N
ID: 68075
SMILES:C1(Oc2cc(O)cc(CCCCC)c2)C(C(O)(C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.655
InChIKey:YMZOUWKPDWVOJH-UHFFFAOYSA-N
ID: 68076
SMILES:CC1(C)CCCC2=Cc3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -10.854
InChIKey:LSESXZFKOGMHHE-UHFFFAOYSA-N
ID: 68077
SMILES:C1(=C)C(O)CCC(C)(C)C2(O)C1c1c(cc(C)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -13.476
InChIKey:HFUTVNHHQPVPDF-UHFFFAOYSA-N
ID: 68078
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC1(C)C(O1)C(Br)CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 477.483
CB1 binding score: -14.292
InChIKey:QZVOTLONIHVONI-UHFFFAOYSA-N
ID: 68079
SMILES:C1(c2ccc(C)cc2)Oc2c(c(O)cc(CCCCCC)c2)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -13.104
InChIKey:PZZDWXDJAJUBCT-UHFFFAOYSA-N
ID: 68080
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.322
InChIKey:RTFCHYBPGIZDPL-UHFFFAOYSA-N
ID: 68081
SMILES:c1c(CCC)cc(O)c2c1OC1(CC2)C(C)CC(=O)C(C(CC(OC)C(CCCC(C)=COC(=O)C)C)(O)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.74
CB1 binding score: -14.111
InChIKey:QNKMBUXCWMXDLQ-UHFFFAOYSA-N
ID: 68082
SMILES:Cc1c2c(c(C)cc1)C(=O)C(c1cc(CCCCC)cc(O)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -11.883
InChIKey:PHQPBAQDZIHXEL-UHFFFAOYSA-N